[Wien] Strange clmsum problem

[Michael Gurnett]

This is what part of the clmsum file looks like

 MIXED TOTAL CHARGE DENSITY IN INTERSTITIAL   NEW TOTAL CHARGE DENSITY

 NUMBER OF PW554441
       0    0    0 NaN                NaN                NaN
NaN       
       0    0   -1 NaN                NaN                NaN
NaN       
       0    0    1 NaN                NaN                NaN
NaN       
       0    0   -2 NaN                NaN                NaN
NaN       
       0    0    2 NaN                NaN                NaN
NaN       
       0    0   -3 NaN        


Thanks
Michael

P.S just noticed the terrible non-descriptive subject

On Sun, 2006-02-26 at 16:40 +0100, Michael Gurnett wrote:
> I installed the latest version of the code Wien2k_06, but was getting
> strange errors regarding the def files and clmsum. This was on cases
> that had been running succesfully on the latest 05 version. I went back
> and reinstalled the latest 05 version, but I seem to be getting errors
> now as well.
> 
> >>> (min) status after run_lapw -I -i 40 -fc 1.0 \: 9 -> exit
> lapw0              0000000000403E29  Unknown               Unknown  Unknown
> libc.so.6          000000351E01C3CF  Unknown               Unknown  Unknown
> lapw0              0000000000403EEA  Unknown               Unknown  Unknown
> lapw0              00000000004281FA  Unknown               Unknown  Unknown
> lapw0              000000000047F0E8  Unknown               Unknown  Unknown
> lapw0              0000000000470040  Unknown               Unknown  Unknown
> lapw0              00000000004703D7  Unknown               Unknown  Unknown
> lapw0              0000000000496D90  Unknown               Unknown  Unknown
> lapw0              00000000004B2D9E  Unknown               Unknown  Unknown
> lapw0              00000000004B503B  Unknown               Unknown  Unknown
> Image              PC                Routine            Line        Source             
> forrtl: severe (64): input conversion error, unit 8, file /home/Michael/Wien2k/HCT-Lisqrt3/HCT-Lisqrt3.clmsum
> broyden files deleted, clm*, dmat*, vorb*, scf and struct files saved under HCT-Lisqrt3_1
> Fallback to compatibility mode with "old" save_lapw
> >>  (mini) arrived at end -> exit
> ec cc and fc_conv 1 1 1
>  MIXER END
>  CORE  END
>  LAPW2 END
>  LAPW1 END
>  LAPW0 END
> 
> What could have happened between the installations
> 
> Michael
> 
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